Home Nitriles 4-AMino-2-(MethoxyMethyl)pyriMidine-5-carbonitrile

4-AMino-2-(MethoxyMethyl)pyriMidine-5-carbonitrile

CAS No.:
76574-34-0
Catalog Number:
AG00GBTU
Molecular Formula:
C7H8N4O
Molecular Weight:
164.1646
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Product Description
Catalog Number:
AG00GBTU
Chemical Name:
4-AMino-2-(MethoxyMethyl)pyriMidine-5-carbonitrile
CAS Number:
76574-34-0
Molecular Formula:
C7H8N4O
Molecular Weight:
164.1646
MDL Number:
MFCD19253056
IUPAC Name:
4-amino-2-(methoxymethyl)pyrimidine-5-carbonitrile
InChI:
InChI=1S/C7H8N4O/c1-12-4-6-10-3-5(2-8)7(9)11-6/h3H,4H2,1H3,(H2,9,10,11)
InChI Key:
JQQQYSOCZGACIM-UHFFFAOYSA-N
SMILES:
COCc1ncc(c(n1)N)C#N
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.07g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
164.168g/mol
Monoisotopic Mass:
164.07g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties